SCHEMBL6448577

SCHEMBL6448577

CN(C)Cc1cccc(C(=N)NO)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 1/20 0.44
MEP1B Q16820 8/20 0.43
MEP1A Q16819 2/20 0.43
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42
F2 P00734 2/20 0.40
F10 P00742 2/20 0.40
HDAC1 Q13547 1/20 0.39
PRSS1 P07477 2/20 0.39
LOXL2 Q9Y4K0 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2B Q13224 1/20 0.38
GRIN2C Q14957 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2774179 0.83 SIGMAR1 (0.43) MEP1BMEP1APRSS1PRSS2PRSS3
SCHEMBL7087183 0.83 MEN1 (0.54) MEP1BMEP1AHDAC1MEN1KMT2A
SCHEMBL5956199 0.81 KAT6A (0.42) MEP1BHDAC1PRSS1LOXL2PRSS2
SCHEMBL2775292 0.80 HDAC6 (0.48) MEP1BMEP1ATSHR
SCHEMBL409611 0.80 MEP1B (0.47) MEP1BMEP1AALDH1A1TSHRPRSS1
SCHEMBL410445 0.79 KDM4E (0.37) MEP1BMEP1APRSS1PRSS2PRSS3
SCHEMBL320097 0.79 PRSS1 (0.61) MEP1BMEP1ATSHRF10HDAC1
SCHEMBL6334369 0.79 HRH3 (0.48) NOS1MEP1BALDH1A1TSHRHDAC1
SCHEMBL7087160 0.78 MEP1B (0.53) MEP1BMEP1AHDAC1MEN1KMT2A
SCHEMBL7083688 0.78 PPARG (0.52) MEP1BMEP1AHDAC1KMT2AGRIN2D

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1423120-A4 2H-PHTHALAZIN-1-ONES AND METHODS FOR USE THEREOF ICOS CORP (US) 2005-12-28 EP disclosed
CN-1568187-A 2H-2,3-dinitrogen phenodiazine-1-ketone and using method thereof ICOS CORP (US) 2005-01-19 CN disclosed
EP-1423120-A1 2H-PHTHALAZIN-1-ONES AND METHODS FOR USE THEREOF ICOS CORPORATION (US) 2004-06-02 EP disclosed
WO-2003015785-A1 2H-PHTHALAZIN-1-ONES AND METHODS FOR USE THEREOF ICOS CORPORATION (US) 2003-02-27 WO disclosed